3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide

C16H28N2O — CID 119803900

IUPAC3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)NC2CC2C2CCCCC2)C1
InChIInChI=1S/C16H28N2O/c17-13-8-4-7-12(9-13)16(19)18-15-10-14(15)11-5-2-1-3-6-11/h11-15H,1-10,17H2,(H,18,19)
InChIKeyCENOHFPSEBOBOT-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.59
Rot. Bonds3

About 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide

3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide (PubChem CID 119803900) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide
PubChem CID119803900
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)NC2CC2C2CCCCC2)C1
InChIInChI=1S/C16H28N2O/c17-13-8-4-7-12(9-13)16(19)18-15-10-14(15)11-5-2-1-3-6-11/h11-15H,1-10,17H2,(H,18,19)
InChIKeyCENOHFPSEBOBOT-UHFFFAOYSA-N
XLogP2.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2-cyclohexylcyclopropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673884
3-amino-N-cyclopropylcyclohexane-1-carboxamide
CID 18071393
3-amino-N-(2-tert-butylcyclohexyl)cyclohexane-1-carboxamide;hydrochloride
CID 119716258
(2S,4S)-N-(2-cyclohexylcyclopropyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120636110
N-(2-cyclohexylcyclopropyl)-1-(cyclopropanecarbonyl)piperidine-3-carboxamide
CID 71929793
N-(2-aminocyclopropyl)cyclohexanecarboxamide
CID 43593715
3-amino-N-(2-hydroxycyclohexyl)cyclopentane-1-carboxamide
CID 66007557
3-amino-N-(4-carbamoylcyclohexyl)cyclohexane-1-carboxamide
CID 63043224
N-[(1R,2S,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopentanecarboxamide
CID 124785473
3-amino-N-(2,2-dimethylcyclohexyl)cyclohexane-1-carboxamide
CID 79878952
3-aminocyclododecane-1-carboxylic acid
CID 71162813
3-amino-N-(2,2-dimethylcyclohexyl)cyclohexane-1-carboxamide;hydrochloride
CID 119790519

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide (CID 119803900) is 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide is NC1CCCC(C(=O)NC2CC2C2CCCCC2)C1.
What is the InChIKey of 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide?
The InChIKey is CENOHFPSEBOBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c17-13-8-4-7-12(9-13)16(19)18-15-10-14(15)11-5-2-1-3-6-11/h11-15H,1-10,17H2,(H,18,19).
What are the key properties of 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide?
3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide has a molecular weight of 264.41 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-cyclohexylcyclopropyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 119803900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).